IFLAB-ZINC05241782 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.2970 -2.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -0.2740 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.3460 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -3.0440 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -4.4190 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -5.1070 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -4.3970 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -3.0220 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -6.5810 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -7.1960 -1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -7.2420 -0.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -8.6250 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -9.3890 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -10.8100 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -11.0800 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -9.6020 -0.9590 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -12.4750 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -13.4930 -0.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4280 -13.4350 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -13.1720 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -11.8790 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -14.9020 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -8.8400 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 -8.4060 1.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -2.5100 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -4.9620 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -4.9230 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -2.4720 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -6.7510 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -12.6460 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -12.5800 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -13.0450 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -13.9890 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 -12.0520 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -11.5530 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -15.1250 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -15.6250 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -14.9590 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 3 0 0 0 0 M END